Geometry & MOs

Info

ID:	256426
PubChem CID:	103139187
Reduced:	N3C13H15 (1)
Stoich.:	A3B13C15 (1)
Weight, g/mol:	250.110613
ΔH_f, kcal/mol:	59.49
Dipole, Da:	3.88
IP(EA), eV:	-7.8(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

isoquinolin-8-yl-(6-methylpyridin-2-yl)methanol

Drug info:

PubChemData

Smile

CC(C=C)NC1=C2C=NC=CC2=C(C=C1)N

DOS

IR

Vibrations